A2762/0117170
TL;DR: A2762/0117170 (CAS 372501-96-7) is a chemical compound with molecular formula C25H24N4OS and molecular weight 428.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-(3-methylphenyl)-16-sulfanylidenespiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13-pentaene-9,1'-cyclohexane]-11-one
Also Known As: A2762/0117170, 1-MERCAPTO-4-(3-METHYLPHENYL)-4H-SPIRO[BENZO[H][1,2,4]TRIAZOLO[4,3-A]QUINAZOLINE-6,1'-CYCLOHEXAN]-5(7H)-ONE, 1-mercapto-4-(m-tolyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one, 4-(3-methylphenyl)-1-sulfanyl-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one, 4-(3-methylphenyl)-1-thioxo-2,4-dihydro-1H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
| Molecular Formula | C25H24N4OS |
|---|---|
| Molecular Weight | 428.17 g/mol |
| LogP | 5.27621 |
| Topological Polar Surface Area | 55.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 428.16708 |
| Heavy Atoms | 31 |
| Complexity | 1452.6464 |
Chemical Identifiers
| CAS Number | 372501-96-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N6C2=NNC6=S |
Product Overview
A2762/0117170 (CAS 372501-96-7), with molecular formula C25H24N4OS and molecular weight 428.17 g/mol. IUPAC: 12-(3-methylphenyl)-16-sulfanylidenespiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13-pentaene-9,1'-cyclohexane]-11-one.
Chemical Property Profile of A2762/0117170
Property Insights of A2762/0117170
The XLogP value of 5.27621 indicates that A2762/0117170 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.09 Ų, A2762/0117170 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A2762/0117170 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2762/0117170?
The CAS number of A2762/0117170 is 372501-96-7.
What is the molecular formula of A2762/0117170?
The molecular formula of A2762/0117170 is C25H24N4OS.
What is the molecular weight of A2762/0117170?
The molecular weight of A2762/0117170 is 428.17 g/mol.
Where can I buy A2762/0117170?
You can request a quote for A2762/0117170 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2762/0117170?
Yes, KEHONG BIO provides custom synthesis services for A2762/0117170 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.